N-[2-(cyclohexylcarbonylamino)-1,3-benzothiazol-5-yl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide

Systemtic Name: N-[2-(cyclohexylcarbonylamino)-1,3-benzothiazol-5-yl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide Openeye Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-5-yl]-5-(2-thienyl)-1H-pyrazole-3-carboxamide CAS Name: N-[2-[[cyclohexyl(oxo)methyl]amino]-1,3-benzothiazol-5-yl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide IUPAC Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-5-yl]-5-thiophen-2-yl-1H-pyrazole-3-carboxamide Traditional Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-5-yl]-5-(2-thienyl)-1H-pyrazole-3-carboxamide Formula: C22H21N5O2S2 MolecularWeight: 451.56444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=CC(=C3)NC(=O)C4=NNC(=C4)C5=CC=CS5

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=CC(=C3)NC(=O)C4=NNC(=C4)C5=CC=CS5

InChI

InChI=1S/C22H21N5O2S2/c28-20(13-5-2-1-3-6-13)25-22-24-15-11-14(8-9-19(15)31-22)23-21(29)17-12-16(26-27-17)18-7-4-10-30-18/h4,7-13H,1-3,5-6H2,(H,23,29)(H,26,27)(H,24,25,28)